BDBM50258929 CHEMBL4072982

SMILES: COCC(NC(=O)N1CC(=O)Nc2cc(cnc12)C1CC1)c1ccc(OC(F)(F)F)cc1

InChI Key: InChIKey=VBLTXKIYSKSANS-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50258929   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Homo sapiens phosphodiesterase 2A (PDE2A) (Homo sapiens (Human))	BDBM50258929 (CHEMBL4072982) Show SMILES COCC(NC(=O)N1CC(=O)Nc2cc(cnc12)C1CC1)c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C21H21F3N4O4/c1-31-11-17(13-4-6-15(7-5-13)32-21(22,23)24)27-20(30)28-10-18(29)26-16-8-14(12-2-3-12)9-25-19(16)28/h4-9,12,17H,2-3,10-11H2,1H3,(H,26,29)(H,27,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company Limited Curated by ChEMBL					Assay Description Inhibition of recombinant human FLAG-tagged PDE2A3 expressed in sf21 cells using [3H]cGMP as substrate by scintillation proximity assay				J Med Chem 60: 7677-7702 (2017) Article DOI: 10.1021/acs.jmedchem.7b00807 BindingDB Entry DOI: 10.7270/Q2P271JR
					More data for this Ligand-Target Pair